Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 2/20 | 0.54 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.54 |
| ▸ | FASN | P49327 | 5/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 5/20 | 0.36 |
| ▸ | HTR2C | P28335 | 5/20 | 0.36 |
| ▸ | HTR2B | P41595 | 5/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.35 |
| ▸ | TYMS | P04818 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 0.33 |
| ▸ | FLT3 | P36888 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL24188340 | 0.84 | PDCD1 (0.48) | PDCD1CD274FASNPARP1HTR2A | |
| SCHEMBL24187941 | 0.75 | PDCD1 (0.62) | PDCD1CD274FASNPARP1HTR2A | |
| SCHEMBL28657952 | 0.71 | PDCD1 (0.48) | PDCD1CD274FASN | |
| SCHEMBL28639322 | 0.71 | PDCD1 (0.48) | PDCD1CD274FASNNISCH | |
| SCHEMBL19559109 | 0.71 | FASN (0.54) | PDCD1CD274FASN | |
| SCHEMBL28646193 | 0.70 | PDCD1 (0.62) | PDCD1CD274FASNHTR2CKDR | |
| SCHEMBL24187953 | 0.70 | PDCD1 (0.62) | PDCD1CD274PARP1HTR2CHTR2B | |
| SCHEMBL24188257 | 0.68 | PDCD1 (0.48) | PDCD1CD274FASNKDRNISCH | |
| SCHEMBL12492799 | 0.68 | PDCD1 (0.68) | PDCD1CD274HTR2AHTR2CHTR2B | |
| SCHEMBL24187984 | 0.68 | PDCD1 (0.60) | PDCD1CD274FASN |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010021381-A1 | FUSED HETEROCYCLIC DERIVATIVE AND USE THEREOF | 武田薬品工業株式会社 (JP) | 2010-02-25 | — | — | WO | disclosed |